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Substance Name: Tamoxifen epoxide
RN: 92137-93-4
InChIKey: XGZWRNUNGZJDNL-FTJBHMTQSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C26-H29-N-O2

Molecular Weight

  • 387.52
 
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Names and Synonyms

Results Name

  • Tamoxifen epoxide

Synonyms

  • (E)-1-(4-(2-Dimethylaminoethoxy)phenyl)-1,2-diphenyl-1,2-dioxobutane
  • (Z)-2-(4-(1,2-Oxodiphenyl-1-butane)phenoxy)-N,N-dimethylethanamine
  • cis-2-(4-(3-Ethyl-2,3-diphenyloxiranyl)phenoxy)-N,N-dimethylethanamine
  • Tamoxifen epoxide

Systematic Name

  • Ethanamine, 2-(4-(3-ethyl-2,3-diphenyloxiranyl)phenoxy)-N,N-dimethyl-, cis-

Registry Numbers

CAS Registry Number

  • 92137-93-4

System Generated Number

  • 0092137934

Structure Descriptors

InChI

1S/C26H29NO2/c1-4-25(21-11-7-5-8-12-21)26(29-25,22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/t25-,26+/m1/s1

InChIKey

XGZWRNUNGZJDNL-FTJBHMTQSA-N

Smiles

O1[C@](CC)(c2ccccc2)[C@]1(c1ccccc1)c1ccc(cc1)OCCN(C)C